C14H21N3OS
TL;DR: C14H21N3OS (CAS 81484-99-3) is a chemical compound with molecular formula C14H21N3OS and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-sulfanylidene-5-[2-(1,5,5-trimethylpyrrolidin-2-ylidene)ethylidene]imidazolidin-4-one
Also Known As: EINECS 279-769-1, 1,3-DIMETHYL-2-SULFANYLIDENE-5-[2-(1,5,5-TRIMETHYLPYRROLIDIN-2-YLIDENE)ETHYLIDENE]IMIDAZOLIDIN-4-ONE, 1,3-Dimethyl-2-thioxo-5-((1,5,5-trimethyl-2-pyrrolidinylidene)ethylidene)imidazolidin-4-one, 1,3-DIMETHYL-2-THIOXO-5-[(1,5,5-TRIMETHYL-2-PYRROLIDINYLIDENE)ETHYLIDENE]IMIDAZOLIDIN-4-ONE, 1,3-Dimethyl-2-thioxo-5-[2-(1,5,5-trimethyl-2-pyrrolidinylidene)ethylidene]-4-imidazolidinone
| Molecular Formula | C14H21N3OS |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 1.9471 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.14053 |
| Heavy Atoms | 19 |
| Complexity | 492.91956 |
Chemical Identifiers
| CAS Number | 81484-99-3 |
|---|---|
| SMILES | CC1(CCC(=CC=C2C(=O)N(C(=S)N2C)C)N1C)C |
Product Overview
C14H21N3OS (CAS 81484-99-3), with molecular formula C14H21N3OS and molecular weight 279.14 g/mol. IUPAC: 1,3-dimethyl-2-sulfanylidene-5-[2-(1,5,5-trimethylpyrrolidin-2-ylidene)ethylidene]imidazolidin-4-one.
Chemical Property Profile of C14H21N3OS
Property Insights of C14H21N3OS
The XLogP value of 1.9471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14H21N3OS. With a topological polar surface area (TPSA) of 26.79 Ų, C14H21N3OS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C14H21N3OS has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C14H21N3OS?
The CAS number of C14H21N3OS is 81484-99-3.
What is the molecular formula of C14H21N3OS?
The molecular formula of C14H21N3OS is C14H21N3OS.
What is the molecular weight of C14H21N3OS?
The molecular weight of C14H21N3OS is 279.14 g/mol.
Where can I buy C14H21N3OS?
You can request a quote for C14H21N3OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C14H21N3OS?
Yes, KEHONG BIO provides custom synthesis services for C14H21N3OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.